(E)-2-cyano-3-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-N-phenyl-prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-N-phenyl-prop-2-enamide Openeye Name: (E)-2-cyano-3-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-N-phenyl-prop-2-enamide CAS Name: (E)-2-cyano-3-[4-(3,5-diphenyl-1-pyrazolyl)phenyl]-N-phenyl-2-propenamide IUPAC Name: (E)-2-cyano-3-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-N-phenylprop-2-enamide Traditional Name: (E)-2-cyano-3-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-N-phenyl-acrylamide Formula: C31H22N4O MolecularWeight: 466.53258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)C=C(C#N)C(=O)NC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)/C=C(\C#N)/C(=O)NC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H22N4O/c32-22-26(31(36)33-27-14-8-3-9-15-27)20-23-16-18-28(19-17-23)35-30(25-12-6-2-7-13-25)21-29(34-35)24-10-4-1-5-11-24/h1-21H,(H,33,36)/b26-20+